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N-{[2-(di-tert-butylphosphanyl)phenyl](2-methylphenyl)methyl}-2-methylpropane-2-sulfinamide

N-{[2-(di-tert-butylphosphanyl)phenyl](2-methylphenyl)methyl}-2-methylpropane-2-sulfinamide

Formula: C26H40NOPS

SMILES: CC1=CC=CC=C1C(NS(=O)C(C)(C)C)C1=CC=CC=C1P(C(C)(C)C)C(C)(C)C

IUPAC: N-{[2-(di-tert-butylphosphanyl)phenyl](2-methylphenyl)methyl}-2-methylpropane-2-sulfinamide

InChI: InChI=1/C26H40NOPS/c1-19-15-11-12-16-20(19)23(27-30(28)26(8,9)10)21-17-13-14-18-22(21)29(24(2,3)4)25(5,6)7/h11-18,23,27H,1-10H3

Composition: C (70.07%), H (9.05%), N (3.14%), O (3.59%), P (6.95%), S (7.19%)

Molar Mass: 445.65

Atom Count: 70

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 2
Exact Mass 445.256823084
Formal Charge 0
FSP3 0.54
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey DDRKSUSIFOAIHS-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 133.26
Topological Polar Surface Area 29.1
Polarizability 53.14
Ring Count 2
Rotatable Bond Count 7

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